SCHEMBL29199855

SCHEMBL29199855

COC(C)(CCOC(C)=O)CCC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.35
CHRM5 P08912 2/20 0.34
CHRM1 P11229 2/20 0.34
CHRM3 P20309 2/20 0.34
TSHR P16473 2/20 0.34
PGR P06401 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
HTR1A P08908 1/20 0.34
CHRNB2 P17787 1/20 0.34
TBXA2R P21731 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CHRNA10 Q9GZZ6 1/20 0.34
CHRNA9 Q9UGM1 1/20 0.34
NAALAD2 Q9Y3Q0 1/20 0.34
GALR3 O60755 2/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL141788 0.79 ALDH1A1 (0.43) ALDH1A1CHRM5CHRM1CHRM3TSHR
SCHEMBL6468564 0.77 NAALAD2 (0.38) ALDH1A1CHRM1TSHRTBXA2RNAALAD2
SCHEMBL29807574 0.76 ALDH1A1 (0.39) ALDH1A1CHRM5CHRM1CHRM3TSHR
SCHEMBL11806205 0.75 ALDH1A1 (0.45) ALDH1A1TSHRNAALAD2ESR1CYP3A4
SCHEMBL28986792 0.74 ALDH1A1 (0.38) ALDH1A1CHRM5CHRM1CHRM3TSHR
SCHEMBL12319731 0.74 ALDH1A1 (0.38) ALDH1A1NAALAD2ESR1CYP3A4ESR2
Acetic Acid SCHEMBL29199856 0.73 ALDH1A1 (0.40) ALDH1A1CHRM5CHRM1CHRM3TSHR
SCHEMBL209783 0.73 NAALAD2 (0.38) ALDH1A1CHRM1TSHRTBXA2RNAALAD2
SCHEMBL11802531 0.73 AKR1B1 (0.48) ALDH1A1TSHRESR1MEN1KMT2A
SCHEMBL22721337 0.72 ALDH1A1 (0.43) ALDH1A1CHRM5CHRM1CHRM3TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110869847-B Photosensitive coloring resin composition, cured product thereof, color filter and display device DNP精细化工股份有限公司 2024-03-08 CN disclosed
CN-110249263-B Photosensitive coloring resin composition, cured product thereof, color filter and display device DNP精细化工股份有限公司 2023-12-08 CN disclosed